1-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-thiourea

Systemtic Name: 1-[(6-bromanyl-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-thiourea Openeye Name: 1-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-thiourea CAS Name: 1-[(6-bromo-4-phenyl-2-quinazolinyl)amino]-3-phenylthiourea IUPAC Name: 1-[(6-bromo-4-phenylquinazolin-2-yl)amino]-3-phenylthiourea Traditional Name: 1-[(6-bromo-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-thiourea Formula: C21H16BrN5S MolecularWeight: 450.35424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NNC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NNC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C21H16BrN5S/c22-15-11-12-18-17(13-15)19(14-7-3-1-4-8-14)25-20(24-18)26-27-21(28)23-16-9-5-2-6-10-16/h1-13H,(H2,23,27,28)(H,24,25,26)